activity
20172021
most citedLink Mining for Kernel-based Compound-Protein Interaction Predictions Using a Chemogenomics Approach

4 citations · 7 across the 5 of their papers we have counts for

collaborators

5 papers

q-bio.BM2021

MEGADOCK-GUI: a GUI-based complete cross-docking tool for exploring protein-protein interactions

Masahito Ohue, Yutaka Akiyama

Information on protein-protein interactions (PPIs) not only advances our understanding of molecular biology but also provides important clues for target selection in drug discovery…

q-bio.BM2021

MEGADOCK-Web-Mito: human mitochondrial protein-protein interaction prediction database

Masahito Ohue, Hiroki Watanabe, Yutaka Akiyama

Mitochondrial diseases are largely caused by dysfunction in mitochondrial proteins. However, annotations of human mitochondrial proteins are scattered across various public databas…

cs.DC2020

High-performance cloud computing for exhaustive protein-protein docking

Masahito Ohue, Kento Aoyama, Yutaka Akiyama

Public cloud computing environments, such as Amazon AWS, Microsoft Azure, and the Google Cloud Platform, have achieved remarkable improvements in computational performance in recen…

q-bio.BM2019★ 3 cited

Molecular activity prediction using graph convolutional deep neural network considering distance on a molecular graph

Masahito Ohue, Ryota Ii, Keisuke Yanagisawa +1

Machine learning is often used in virtual screening to find compounds that are pharmacologically active on a target protein. The weave module is a type of graph convolutional deep…

q-bio.QM2017★ 4 cited

Link Mining for Kernel-based Compound-Protein Interaction Predictions Using a Chemogenomics Approach

Masahito Ohue, Takuro Yamazaki, Tomohiro Ban +1

Virtual screening (VS) is widely used during computational drug discovery to reduce costs. Chemogenomics-based virtual screening (CGBVS) can be used to predict new compound-protein…